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BDBM50085194 2-{Cyclohexyl-[4-(quinolin-2-ylmethoxy)-phenyl]-methoxyimino}-4-phenyl-butyric acid (0.5H2O)::CHEMBL161965

SMILES: OC(=O)C(\CCc1ccccc1)=N\OC(C1CCCCC1)c1ccc(OCc2ccc3ccccc3n2)cc1

InChI Key: InChIKey=KGTNQRZRKHIXEI-JSLDZMDGSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50085194   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Arachidonate 5-lipoxygenase


(Homo sapiens (Human))
BDBM50085194
PNG
(2-{Cyclohexyl-[4-(quinolin-2-ylmethoxy)-phenyl]-me...)
Show SMILES OC(=O)C(\CCc1ccccc1)=N\OC(C1CCCCC1)c1ccc(OCc2ccc3ccccc3n2)cc1
Show InChI InChI=1S/C33H34N2O4/c36-33(37)31(22-15-24-9-3-1-4-10-24)35-39-32(26-12-5-2-6-13-26)27-17-20-29(21-18-27)38-23-28-19-16-25-11-7-8-14-30(25)34-28/h1,3-4,7-11,14,16-21,26,32H,2,5-6,12-13,15,22-23H2,(H,36,37)/b35-31+
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MMDB

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PubMed
n/an/a 20n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of calcium ionophore (A-23187)-stimulated LTB4 formation in human neutrophil assay


J Med Chem 43: 690-705 (2000)


BindingDB Entry DOI: 10.7270/Q2HD7WCR
More data for this
Ligand-Target Pair